3-bromanyl-4-ethoxy-N-[1-(4-imidazol-1-ylphenyl)ethyl]-5-methoxy-benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-[1-(4-imidazol-1-ylphenyl)ethyl]-5-methoxy-benzamide Openeye Name: 3-bromo-4-ethoxy-N-[1-(4-imidazol-1-ylphenyl)ethyl]-5-methoxy-benzamide CAS Name: 3-bromo-4-ethoxy-N-[1-[4-(1-imidazolyl)phenyl]ethyl]-5-methoxybenzamide IUPAC Name: 3-bromo-4-ethoxy-N-[1-(4-imidazol-1-ylphenyl)ethyl]-5-methoxybenzamide Traditional Name: 3-bromo-4-ethoxy-N-[1-(4-imidazol-1-ylphenyl)ethyl]-5-methoxy-benzamide Formula: C21H22BrN3O3 MolecularWeight: 444.32168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)NC(C)C2=CC=C(C=C2)N3C=CN=C3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)NC(C)C2=CC=C(C=C2)N3C=CN=C3)OC

InChI

InChI=1S/C21H22BrN3O3/c1-4-28-20-18(22)11-16(12-19(20)27-3)21(26)24-14(2)15-5-7-17(8-6-15)25-10-9-23-13-25/h5-14H,4H2,1-3H3,(H,24,26)